chainer chainer-chemistry issues

chainer / chainer-chemistry

Chainer Chemistry: A Library for Deep Learning in Biology and Chemistry

MIT License

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issues

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hello

#429 Anupama-19 opened 1 year ago
0
CVE-2007-4559 Patch

#428 TrellixVulnTeam opened 1 year ago
0
Remove typing dependency

#427 mottodora closed 3 years ago
2
v0.7.1

#426 corochann closed 3 years ago
1
Refactor wle

#425 corochann closed 3 years ago
1
Fix errors for RSGCN-CWLE/GWLE

#424 k-ishiguro closed 3 years ago
1
update fix base chainer version to be 7.0.0

#423 corochann opened 3 years ago
5
WL EMbedding

#422 k-ishiguro closed 3 years ago
4
Can I early stopping?

#421 rookiecoder-chen opened 4 years ago
0
about transfer learning

#420 rookiecoder-chen opened 4 years ago
4
The number of input and output is inconsistent when using my own data for prediction

#419 rookiecoder-chen opened 4 years ago
0
Random seed is useless in get_molnet_dataset function

#418 Minys233 opened 4 years ago
1
Minor revision about example scripts

#417 Minys233 opened 4 years ago
1
Relgat example not given

#416 Ujwal2910 closed 4 years ago
2
A little question

#415 rookiecoder-chen opened 4 years ago
6
Kekulized QM9

#414 nshervt closed 4 years ago
2
fix flake8

#413 corochann closed 4 years ago
3
make directory in molnet example if not exist

#412 mottodora closed 4 years ago
3
update version to 0.7.0

#411 corochann closed 4 years ago
1
Do you also stop developing chainer chemistry?

#410 hori1537 opened 4 years ago
4
Fix megnet

#409 corochann closed 4 years ago
5
Can chainer chemistry do molecular generation or design tasks?

#408 rookiecoder-chen opened 4 years ago
1
Can we transfer learning?

#407 hori1537 closed 4 years ago
10
Numpy related error in NFP tutorial

#406 nshervt closed 3 years ago
7
Add cgcnn megnet

#405 corochann closed 4 years ago
5
QM9 with coordinates

#404 nshervt closed 4 years ago
2
MP auto download

#403 corochann closed 4 years ago
7
Chainer graph refactor

#402 corochann closed 4 years ago
3
Add tests for sparse models and coo models

#401 knshnb opened 4 years ago
0
Support downloading network datasets automatically

#400 knshnb opened 4 years ago
0
Weight tying option has a bug

#399 knshnb opened 4 years ago
1
Chainer graph

#398 knshnb closed 4 years ago
6
Use as_variable instead of isinstance

#397 ktns closed 4 years ago
2
Crystal Support

#396 nissy-dev closed 4 years ago
2
add shifted softplus

#395 mist714 closed 4 years ago
2
Activation function of SchNet should be ShiftedSoftPlus.

#394 mottodora opened 4 years ago
0
Kekulize

#393 mist714 closed 4 years ago
3
update version to v0.6.0

#392 corochann closed 4 years ago
0
support more models in example

#391 corochann closed 4 years ago
2
addHs in SchNet preprocess

#390 mottodora closed 4 years ago
3
update test

#389 corochann closed 4 years ago
0
return svg text in MolVisualizer

#388 corochann closed 4 years ago
2
Remove IPython dependency

#387 dtaniwaki closed 4 years ago
4
Graph film v2

#386 corochann closed 4 years ago
8
[WIP] MEGNet

#385 nissy-dev closed 4 years ago
0
ImportError: cannot import name 'set_up_predictor'

#384 fr-takumaurata closed 4 years ago
2
add gwm preprocessor test

#383 corochann closed 4 years ago
3
Train utils

#382 corochann closed 4 years ago
6
New Flexci test environment

#381 mottodora closed 4 years ago
17
flexci test environment

#380 corochann closed 4 years ago
0